[(E)-6-azanyl-5-methyl-2,4-bis(oxidanylidene)hept-5-en-3-yl] benzoate

Systemtic Name: [(E)-6-azanyl-5-methyl-2,4-bis(oxidanylidene)hept-5-en-3-yl] benzoate Openeye Name: [(E)-1-acetyl-4-amino-3-methyl-2-oxo-pent-3-enyl] benzoate CAS Name: benzoic acid [(E)-6-amino-5-methyl-2,4-dioxohept-5-en-3-yl] ester IUPAC Name: [(E)-6-amino-5-methyl-2,4-dioxohept-5-en-3-yl] benzoate Traditional Name: benzoic acid [(E)-1-acetyl-4-amino-2-keto-3-methyl-pent-3-enyl] ester Formula: C15H17NO4 MolecularWeight: 275.29978

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C(=O)C(=C(C)N)C)OC(=O)C1=CC=CC=C1

Isomeric SMILES

CC(=O)C(C(=O)/C(=C(\C)/N)/C)OC(=O)C1=CC=CC=C1

InChI

InChI=1S/C15H17NO4/c1-9(10(2)16)13(18)14(11(3)17)20-15(19)12-7-5-4-6-8-12/h4-8,14H,16H2,1-3H3/b10-9+